1-naphthalen-1-yl-3-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]urea

Systemtic Name: 1-naphthalen-1-yl-3-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]urea Openeye Name: 1-(1-naphthyl)-3-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]urea CAS Name: 1-(1-naphthalenyl)-3-[4-[4-(3,5,5-trimethyl-1-oxohexyl)-1-piperazinyl]phenyl]urea IUPAC Name: 1-naphthalen-1-yl-3-[4-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]phenyl]urea Traditional Name: 1-(1-naphthyl)-3-[4-[4-(3,5,5-trimethylhexanoyl)piperazino]phenyl]urea Formula: C30H38N4O2 MolecularWeight: 486.64832

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=CC4=CC=CC=C43)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=CC4=CC=CC=C43)CC(C)(C)C

InChI

InChI=1S/C30H38N4O2/c1-22(21-30(2,3)4)20-28(35)34-18-16-33(17-19-34)25-14-12-24(13-15-25)31-29(36)32-27-11-7-9-23-8-5-6-10-26(23)27/h5-15,22H,16-21H2,1-4H3,(H2,31,32,36)